2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one

C12H10N4O — CID 135408195

IUPAC2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one
SMILESCc1nn2cc(-c3ccccc3)nc2[nH]c1=O
InChIInChI=1S/C12H10N4O/c1-8-11(17)14-12-13-10(7-16(12)15-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,13,14,17)
InChIKeyUZAFRHFIXAKVPM-UHFFFAOYSA-N
MW226.24 g/mol
LogP1.39
Rot. Bonds1

About 2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one

2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one (PubChem CID 135408195) has the molecular formula C12H10N4O and a molecular weight of 226.24 g/mol. Its IUPAC name is 2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one.

Molecular Properties

Compound Name2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one
PubChem CID135408195
Molecular FormulaC12H10N4O
Molecular Weight226.24 g/mol
Exact Mass226.09
IUPAC Name2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one
SMILESCc1nn2cc(-c3ccccc3)nc2[nH]c1=O
InChIInChI=1S/C12H10N4O/c1-8-11(17)14-12-13-10(7-16(12)15-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,13,14,17)
InChIKeyUZAFRHFIXAKVPM-UHFFFAOYSA-N
XLogP1.39
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one?
The IUPAC name of 2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one (CID 135408195) is 2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one.
What is the SMILES notation for 2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one?
The canonical SMILES for 2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one is Cc1nn2cc(-c3ccccc3)nc2[nH]c1=O.
What is the InChIKey of 2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one?
The InChIKey is UZAFRHFIXAKVPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O/c1-8-11(17)14-12-13-10(7-16(12)15-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,13,14,17).
What are the key properties of 2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one?
2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one has a molecular weight of 226.24 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-phenyl-4H-imidazo[1,2-b][1,2,4]triazin-3-one is sourced from PubChem (CID 135408195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).